3-(4-methoxyanilino)-4-(5,6,7,8-tetrahydronaphthalen-2-yl)cyclobut-3-ene-1,2-dione
Chemical Structure Depiction of
3-(4-methoxyanilino)-4-(5,6,7,8-tetrahydronaphthalen-2-yl)cyclobut-3-ene-1,2-dione
3-(4-methoxyanilino)-4-(5,6,7,8-tetrahydronaphthalen-2-yl)cyclobut-3-ene-1,2-dione
Compound characteristics
| Compound ID: | E959-0865 |
| Compound Name: | 3-(4-methoxyanilino)-4-(5,6,7,8-tetrahydronaphthalen-2-yl)cyclobut-3-ene-1,2-dione |
| Molecular Weight: | 333.39 |
| Molecular Formula: | C21 H19 N O3 |
| Smiles: | COc1ccc(cc1)NC1=C(C(C1=O)=O)c1ccc2CCCCc2c1 |
| Stereo: | ACHIRAL |
| logP: | 4.5176 |
| logD: | 4.5175 |
| logSw: | -4.4174 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.359 |
| InChI Key: | NGVWFPFZJBTFDE-UHFFFAOYSA-N |